SCHEMBL9270246

SCHEMBL9270246

Cn1c(=O)c(C(=S)N(c2ccccc2)C(C)(C)C)c(O)c2cc(Cl)ccc21

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 6/20 0.47
▸ KMT2A Q03164 6/20 0.47
▸ PGR P06401 1/20 0.47
▸ GSK3B P49841 2/20 0.43
▸ ALDH1A1 P00352 4/20 0.43
▸ KDM4E B2RXH2 3/20 0.40
▸ GAA P10253 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ EGFR P00533 1/20 0.40
▸ CYP2C19 P33261 1/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ HIF1A Q16665 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8085817 0.86 MEN1 (0.56) MEN1KMT2APGRGSK3BALDH1A1
SCHEMBL9269029 0.81 MEN1 (0.46) MEN1KMT2APGRGSK3BALDH1A1
SCHEMBL9279359 0.79 MEN1 (0.56) MEN1KMT2APGRGSK3BALDH1A1
SCHEMBL10674315 0.78 MEN1 (0.74) MEN1KMT2APGRGSK3BALDH1A1
SCHEMBL9284056 0.76 GSK3B (0.46) MEN1KMT2APGRGSK3BALDH1A1
SCHEMBL11372872 0.75 GSK3B (0.57) MEN1KMT2APGRGSK3BALDH1A1
SCHEMBL8086963 0.74 GSK3B (0.43) MEN1KMT2APGRGSK3BALDH1A1
SCHEMBL10674186 0.72 EGFR (0.69) MEN1KMT2AGSK3BALDH1A1KDM4E
SCHEMBL31469733 0.71 GABRA1 (0.54) MEN1KMT2AGSK3BALDH1A1KDM4E
SCHEMBL9287554 0.71 GSK3B (0.41) MEN1KMT2APGRGSK3BALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1995024395-A1 QUINOLINE DERIVATIVES AS IMMUNOMODULATORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-09-14 — — WO disclosed
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